Geometry & MOs

Info

ID:	272382
PubChem CID:	103740666
Reduced:	F2N2O4C13H14 (1)
Stoich.:	A2B2C4D13E14 (1)
Weight, g/mol:	298.112899
ΔH_f, kcal/mol:	-140.95
Dipole, Da:	6.56
IP(EA), eV:	-10.21(-1.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-difluoro-N-[(1-methylcyclopentyl)methyl]-3-nitrobenzamide

Drug info:

PubChemData

Smile

C1CC1COCCNC(=O)C2=C(C=CC(=C2F)[N+](=O)[O-])F

DOS

IR

Vibrations